3-[[4-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)carbonyl]phenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[4-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)carbonyl]phenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[4-(4-phenyl-3,6-dihydro-2H-pyridine-1-carbonyl)phenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione CAS Name: 3-[[4-[oxo-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phenyl]methylamino]-4-(1-pyrrolidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[4-(4-phenyl-3,6-dihydro-2H-pyridine-1-carbonyl)phenyl]methylamino]-4-pyrrolidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[4-(4-phenyl-3,6-dihydro-2H-pyridine-1-carbonyl)benzyl]amino]-4-pyrrolidino-cyclobut-3-ene-1,2-quinone Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C(=O)N4CCC(=CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C(=O)N4CCC(=CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O3/c31-25-23(24(26(25)32)29-14-4-5-15-29)28-18-19-8-10-22(11-9-19)27(33)30-16-12-21(13-17-30)20-6-2-1-3-7-20/h1-3,6-12,28H,4-5,13-18H2